6H-naphthalen-6-ide-1-carbaldehyde;yttrium

C11H7OY- — CID 58541113

IUPAC6H-naphthalen-6-ide-1-carbaldehyde;yttrium
SMILESO=Cc1cccc2c[c-]ccc12.[Y]
InChIInChI=1S/C11H7O.Y/c12-8-10-6-3-5-9-4-1-2-7-11(9)10;/h2-8H;/q-1;
InChIKeySIJAHUSVWCLYGB-UHFFFAOYSA-N
MW244.08 g/mol
LogP2.45
Rot. Bonds1

About 6H-naphthalen-6-ide-1-carbaldehyde;yttrium

6H-naphthalen-6-ide-1-carbaldehyde;yttrium (PubChem CID 58541113) has the molecular formula C11H7OY- and a molecular weight of 244.08 g/mol. Its IUPAC name is 6H-naphthalen-6-ide-1-carbaldehyde;yttrium.

Molecular Properties

Compound Name6H-naphthalen-6-ide-1-carbaldehyde;yttrium
PubChem CID58541113
Molecular FormulaC11H7OY-
Molecular Weight244.08 g/mol
Exact Mass243.96
IUPAC Name6H-naphthalen-6-ide-1-carbaldehyde;yttrium
SMILESO=Cc1cccc2c[c-]ccc12.[Y]
InChIInChI=1S/C11H7O.Y/c12-8-10-6-3-5-9-4-1-2-7-11(9)10;/h2-8H;/q-1;
InChIKeySIJAHUSVWCLYGB-UHFFFAOYSA-N
XLogP2.45
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.08
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

naphthalene-1-carbaldehyde;zinc
CID 88790891
naphthalene-1-carbaldehyde;hydroiodide
CID 172736279
sodium 2-chlorobenzene-5-ide-1-carbaldehyde
CID 165152527
CID 174925205
CID 174925205
7-methylnaphthalene-1-carbaldehyde
CID 15657410
6-prop-1-enylnaphthalene-1-carbaldehyde
CID 154252923
copper(1+);2H-naphthalen-2-ide
CID 150131052
7-(bromomethyl)naphthalene-1-carbaldehyde
CID 118815566
3-chloronaphthalene-1-carbaldehyde
CID 18673614
1-(2-hydroxy-3,6-dihydronaphthalene-3,6-diid-1-yl)-3,6-dihydronaphthalene-3,6-diid-2-ol;docosakis(yttrium)
CID 59985034
2H-naphthalen-2-ide;zinc;hydrobromide
CID 175011397
2-methoxy-3-naphthalen-1-ylbenzaldehyde
CID 10879893

Frequently Asked Questions

What is the IUPAC name of 6H-naphthalen-6-ide-1-carbaldehyde;yttrium?
The IUPAC name of 6H-naphthalen-6-ide-1-carbaldehyde;yttrium (CID 58541113) is 6H-naphthalen-6-ide-1-carbaldehyde;yttrium.
What is the SMILES notation for 6H-naphthalen-6-ide-1-carbaldehyde;yttrium?
The canonical SMILES for 6H-naphthalen-6-ide-1-carbaldehyde;yttrium is O=Cc1cccc2c[c-]ccc12.[Y].
What is the InChIKey of 6H-naphthalen-6-ide-1-carbaldehyde;yttrium?
The InChIKey is SIJAHUSVWCLYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7O.Y/c12-8-10-6-3-5-9-4-1-2-7-11(9)10;/h2-8H;/q-1;.
What are the key properties of 6H-naphthalen-6-ide-1-carbaldehyde;yttrium?
6H-naphthalen-6-ide-1-carbaldehyde;yttrium has a molecular weight of 244.08 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-naphthalen-6-ide-1-carbaldehyde;yttrium is sourced from PubChem (CID 58541113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).